COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK848365
Chemical Name: 1,3-dimethyl-8-(4-methylpiperidin-1-yl)-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)c1nc2c(n1CCSc1nccc(n1)C)c(=O)n(c(=O)n2C)C

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Molecular Weight: 429.55
Empirical Formula: C20H27N7O2S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 2.914
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 112
Number of rings: 4

     

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